SCHEMBL8908817

SCHEMBL8908817

COc1ccc(CC(OC(=O)N(C(Cc2c[nH]cn2)C(N)=O)[C@@H](CC2CCCCC2)[C@@H](O)[C@@H](O)C2CC2)C(N)=O)cc1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
REN P00797 16/20 0.38
PSMB8 P28062 4/20 0.32
PSMB5 P28074 2/20 0.32
PSMB9 P28065 2/20 0.32
PSMB10 P40306 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8910205 0.87 GPR132 (0.36) REN
SCHEMBL8908823 0.84 REN (0.34) RENPSMB8PSMB5PSMB9PSMB10
SCHEMBL8910252 0.80 KDM4E (0.39) REN
SCHEMBL8909690 0.74 REN (0.36) REN
Hydrochloric Acid SCHEMBL9800528 0.73 REN (0.52) REN
SCHEMBL8910700 0.73 REN (0.40) REN
SCHEMBL8909458 0.73 PYGL (0.36) REN
SCHEMBL7428433 0.73 REN (0.51) RENPSMB5
SCHEMBL8909154 0.72 REN (0.41) REN
SCHEMBL8910563 0.71 REN (0.41) REN

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5688946-A DIPEPTIDES FOR HYPOTENSIVE AGENTS AND CARDIOVASCULAR DISORDERS HOFFMANN LA ROCHE INC. (US) 1997-11-18 US disclosed